>compound L-Valine_L-Valine
#instrument UPLC Q-Tof Premier, Waters
>formula C5H11NO2
#smiles CC(C)[C@H](N)C(O)=O
#RECORD LC-ESI-QTOF_train_data/PR100588.txt;LC-ESI-QTOF_train_data/PR100176.txt
>charge -1
>ionization [M-H]-
>parentmass 116.07117

>collision 5-60
116.0712 110.6

>collision 5-60
55.0552 21.99
72.0809 1035.0
118.0868 81.11

